[4-(3-methyl-2-pyridinyl)piperazin-1-yl]-(tetrazolo[1,5-a]pyridin-6-yl)methanone

C16H17N7O — CID 70732499

IUPAC[4-(3-methyl-2-pyridinyl)piperazin-1-yl]-(tetrazolo[1,5-a]pyridin-6-yl)methanone
SMILESCc1cccnc1N1CCN(C(=O)c2ccc3nnnn3c2)CC1
InChIInChI=1S/C16H17N7O/c1-12-3-2-6-17-15(12)21-7-9-22(10-8-21)16(24)13-4-5-14-18-19-20-23(14)11-13/h2-6,11H,7-10H2,1H3
InChIKeyRRYWZUPAMZVLJU-UHFFFAOYSA-N
MW323.36 g/mol
LogP0.79
Rot. Bonds2

About [4-(3-methyl-2-pyridinyl)piperazin-1-yl]-(tetrazolo[1,5-a]pyridin-6-yl)methanone

[4-(3-methyl-2-pyridinyl)piperazin-1-yl]-(tetrazolo[1,5-a]pyridin-6-yl)methanone (PubChem CID 70732499) has the molecular formula C16H17N7O and a molecular weight of 323.36 g/mol. Its IUPAC name is [4-(3-methyl-2-pyridinyl)piperazin-1-yl]-(tetrazolo[1,5-a]pyridin-6-yl)methanone.

Molecular Properties

Compound Name[4-(3-methyl-2-pyridinyl)piperazin-1-yl]-(tetrazolo[1,5-a]pyridin-6-yl)methanone
PubChem CID70732499
Molecular FormulaC16H17N7O
Molecular Weight323.36 g/mol
Exact Mass323.15
IUPAC Name[4-(3-methyl-2-pyridinyl)piperazin-1-yl]-(tetrazolo[1,5-a]pyridin-6-yl)methanone
SMILESCc1cccnc1N1CCN(C(=O)c2ccc3nnnn3c2)CC1
InChIInChI=1S/C16H17N7O/c1-12-3-2-6-17-15(12)21-7-9-22(10-8-21)16(24)13-4-5-14-18-19-20-23(14)11-13/h2-6,11H,7-10H2,1H3
InChIKeyRRYWZUPAMZVLJU-UHFFFAOYSA-N
XLogP0.79
TPSA79.52 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.36
LogP ≤ 50.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze [4-(3-methyl-2-pyridinyl)piperazin-1-yl]-(tetrazolo[1,5-a]pyridin-6-yl)methanone with MolForge

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Related Compounds

[4-(cyclopropylmethyl)piperazin-1-yl]-(tetrazolo[1,5-a]pyridin-6-yl)methanone
CID 84586833
[4-(2-methoxyphenoxy)piperidin-1-yl]-(tetrazolo[1,5-a]pyridin-6-yl)methanone
CID 70732957
[4-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazin-1-yl]-(tetrazolo[1,5-a]pyridin-6-yl)methanone
CID 95715309
2-[4-[3-methyl-4-(tetrazol-1-yl)benzoyl]piperazin-1-yl]pyridine-3-carbonitrile
CID 55616156
[(3S,4S)-3,4-dihydroxy-4-methyl-1-oxa-9-azaspiro[5.5]undecan-9-yl]-(tetrazolo[1,5-a]pyridin-6-yl)methanone
CID 163305437
(4-ethyl-2-methyl-1,3-thiazol-5-yl)-[4-(3-methyl-2-pyridinyl)piperazin-1-yl]methanone
CID 70712734
1-methyl-4-(3-methyl-2-pyridinyl)piperazine
CID 46739573
ethyl 2-[4-(4-bromobenzoyl)piperazin-1-yl]pyridine-3-carboxylate
CID 133469644
(9-propan-2-yl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-(tetrazolo[1,5-a]pyridin-6-yl)methanone
CID 75426017
[(2R)-2-phenylmorpholin-4-yl]-(tetrazolo[1,5-a]pyridin-6-yl)methanone
CID 96558365
[(1S)-2,3-dihydro-1H-inden-1-yl]-[4-(3-methyl-2-pyridinyl)piperazin-1-yl]methanone
CID 97189343
[4-(2-methylphenyl)piperazin-1-yl]-(6-methyl-3-pyridinyl)methanone
CID 18147919

Frequently Asked Questions

What is the IUPAC name of [4-(3-methyl-2-pyridinyl)piperazin-1-yl]-(tetrazolo[1,5-a]pyridin-6-yl)methanone?
The IUPAC name of [4-(3-methyl-2-pyridinyl)piperazin-1-yl]-(tetrazolo[1,5-a]pyridin-6-yl)methanone (CID 70732499) is [4-(3-methyl-2-pyridinyl)piperazin-1-yl]-(tetrazolo[1,5-a]pyridin-6-yl)methanone.
What is the SMILES notation for [4-(3-methyl-2-pyridinyl)piperazin-1-yl]-(tetrazolo[1,5-a]pyridin-6-yl)methanone?
The canonical SMILES for [4-(3-methyl-2-pyridinyl)piperazin-1-yl]-(tetrazolo[1,5-a]pyridin-6-yl)methanone is Cc1cccnc1N1CCN(C(=O)c2ccc3nnnn3c2)CC1.
What is the InChIKey of [4-(3-methyl-2-pyridinyl)piperazin-1-yl]-(tetrazolo[1,5-a]pyridin-6-yl)methanone?
The InChIKey is RRYWZUPAMZVLJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N7O/c1-12-3-2-6-17-15(12)21-7-9-22(10-8-21)16(24)13-4-5-14-18-19-20-23(14)11-13/h2-6,11H,7-10H2,1H3.
What are the key properties of [4-(3-methyl-2-pyridinyl)piperazin-1-yl]-(tetrazolo[1,5-a]pyridin-6-yl)methanone?
[4-(3-methyl-2-pyridinyl)piperazin-1-yl]-(tetrazolo[1,5-a]pyridin-6-yl)methanone has a molecular weight of 323.36 g/mol, XLogP of 0.79, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3-methyl-2-pyridinyl)piperazin-1-yl]-(tetrazolo[1,5-a]pyridin-6-yl)methanone is sourced from PubChem (CID 70732499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).